6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine

C18H19N — CID 163424579

IUPAC6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine
SMILESNC1C=CC=CC1C1C=CC=C(c2ccccc2)C1
InChIInChI=1S/C18H19N/c19-18-12-5-4-11-17(18)16-10-6-9-15(13-16)14-7-2-1-3-8-14/h1-12,16-18H,13,19H2
InChIKeyALJASWBRXJYWHU-UHFFFAOYSA-N
MW249.36 g/mol
LogP3.72
Rot. Bonds2

About 6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine

6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine (PubChem CID 163424579) has the molecular formula C18H19N and a molecular weight of 249.36 g/mol. Its IUPAC name is 6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine.

Molecular Properties

Compound Name6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine
PubChem CID163424579
Molecular FormulaC18H19N
Molecular Weight249.36 g/mol
Exact Mass249.15
IUPAC Name6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine
SMILESNC1C=CC=CC1C1C=CC=C(c2ccccc2)C1
InChIInChI=1S/C18H19N/c19-18-12-5-4-11-17(18)16-10-6-9-15(13-16)14-7-2-1-3-8-14/h1-12,16-18H,13,19H2
InChIKeyALJASWBRXJYWHU-UHFFFAOYSA-N
XLogP3.72
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.36
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-phenyl-4-[1-(5-phenylcyclohexa-2,4-dien-1-yl)ethenyl]benzene
CID 145232510
[4-(5-methylcyclohexa-1,3-dien-1-yl)phenyl]methanamine
CID 146244829
[3-(5-methylcyclohexa-2,4-dien-1-yl)cyclohexa-1,3-dien-1-yl]benzene
CID 123713817
3-phenylbicyclo[3.1.0]hex-2-ene
CID 13395700
9-methyl-2-(5-phenylcyclohexa-2,4-dien-1-yl)-4,4a-dihydro-1,10-phenanthroline
CID 167107198
3-(5-methylcyclohexa-1,3-dien-1-yl)-5-phenyl-N-(4-phenylphenyl)aniline
CID 154955387
(1R)-4-phenylcyclohex-3-en-1-amine
CID 86306547
(5-methylcyclohexen-1-yl)benzene
CID 56998306
(1R)-3-phenylcyclohex-3-en-1-amine
CID 175905363
1-[5-(5-methylcyclohexa-2,4-dien-1-yl)cyclohexa-1,3-dien-1-yl]-3-phenylbenzene;9-[4-methyl-3-(2-methylphenyl)phenyl]carbazole
CID 142356437
3-phenyl-6-[6-phenyl-9-[3-(4-phenylphenyl)phenyl]carbazol-3-yl]-9-[3-[5-[3-[3-(3-phenylphenyl)-5-[3-[4-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]cyclohexa-2,4-dien-1-yl]phenyl]carbazole
CID 177124486
N,N-diphenyl-3-[5-(N-[3-[3-(N-[3-[5-(N-phenylanilino)cyclohexa-1,3-dien-1-yl]phenyl]anilino)phenyl]phenyl]anilino)cyclohexa-1,3-dien-1-yl]aniline
CID 59110985

Frequently Asked Questions

What is the IUPAC name of 6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine?
The IUPAC name of 6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine (CID 163424579) is 6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine.
What is the SMILES notation for 6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine?
The canonical SMILES for 6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine is NC1C=CC=CC1C1C=CC=C(c2ccccc2)C1.
What is the InChIKey of 6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine?
The InChIKey is ALJASWBRXJYWHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N/c19-18-12-5-4-11-17(18)16-10-6-9-15(13-16)14-7-2-1-3-8-14/h1-12,16-18H,13,19H2.
What are the key properties of 6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine?
6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine has a molecular weight of 249.36 g/mol, XLogP of 3.72, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-phenylcyclohexa-2,4-dien-1-yl)cyclohexa-2,4-dien-1-amine is sourced from PubChem (CID 163424579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).